{"id":"W4389305377","doi":"10.1103/physrevb.108.245108","title":"Influence of a realistic multiorbital band structure on conducting domain walls in perovskite ferroelectrics","year":2023,"lang":"en","type":"article","venue":"Physical review. B./Physical review. B","topic":"Electronic and Structural Properties of Oxides","field":"Materials Science","cited_by":2,"is_retracted":false,"has_abstract":true,"ca_institutions":"Trent University","funders":"Natural Sciences and Engineering Research Council of Canada; Compute Canada","keywords":"Condensed matter physics; Electron; Mesoscopic physics; Physics; Electronic band structure; Electron density; Zigzag; Ferroelectricity; Domain wall (magnetism); Materials science; Polarization (electrochemistry); Quantum mechanics; Magnetization; Magnetic field; Chemistry; Dielectric; Geometry","routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":false},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow"],"consensus_categories":[],"category_scores_codex":[0.0006781071,0.0005378106,0.001708796,0.00009909952,0.0001333606,0.00003982519,0.0007578504,0.00006317679,0.00004791476],"category_scores_gemma":[0.002556626,0.0003771262,0.0003939209,0.001494305,0.0002843806,0.000374082,0.0001592725,0.0006961884,0.0002813345],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001735617,"about_ca_system_score_gemma":0.0001245199,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0001010655,"about_ca_topic_score_gemma":0.00001368611,"domain_scores_codex":[0.9958976,0.0004739757,0.0009507633,0.0008427635,0.0009163266,0.000918599],"domain_scores_gemma":[0.9976326,0.0007349321,0.0004750003,0.0007302414,0.0002127174,0.000214544],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.00005746614,0.0001682604,0.0001364274,0.006917318,0.00002203954,0.00002703313,0.0002208035,0.0006719464,0.9549296,0.03117867,0.000878963,0.004791404],"study_design_scores_gemma":[0.002458794,0.00291105,0.02002328,0.06549389,0.000771563,0.00006224986,0.0000952375,0.01143768,0.5548481,0.3348556,0.003493759,0.003548823],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.985474,0.01207399,0.00001655181,0.0008815114,0.00006522652,0.001080536,0.00006559944,0.0001086588,0.0002339102],"genre_scores_gemma":[0.980065,0.01816266,0.00008561859,0.001273003,0.0002051673,0.00008368557,0.00004657042,0.00004734744,0.00003098553],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.4000816,"threshold_uncertainty_score":0.9998681,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02901340139825357,"score_gpt":0.3613590398489038,"score_spread":0.3323456384506502,"validation_status":"score_only:v0-immature-baseline","note":"Baseline scores from an immature model (maturity gate not passed). Scores rank; they never assert a category."}}